国家/地区 Iran（3） China（2）
关键词 AB INITIO CALCULATION（10）
出版物 CHEMPHYSCHEM（2） JOURNAL OF MOLECULA.（2） MATERIALS CHEMISTRY.（2）
出版时间 2014（10）
机构 ISLAMIC AZAD.（2）
作者 GANJI MD（3） AHANGARI MG（2） FEREIDOON A（2） KHOSRAVI A（2）

Carborane-wheeled nanocar moving on graphene/graphyne surfaces: van der Waals corrected density functional theory study

MATERIALS CHEMISTRY PHYSICS

GANJI MD, AHANGARI MG, EMAMI SM

Columnar organization of stack-assembled trimesic acid on graphene

JOURNAL OF PHYSICSCONDENSED MATTER

SHAYEGANFAR F

Slide Fastener Reduction of Graphene-Oxide Edges by Calcium: Insight from Ab Initio Molecular Dynamics

CHEMPHYSCHEM

XIE SY, LI XB, TIAN WQ, WANG D, CHEN NK, HAN D, SUN HB

Rules of Boron-Nitrogen Doping in Defect Graphene Sheets: A First-Principles Investigation of Band-Gap Tuning and Oxygen Reduction Reaction Catalysis Capabilities

CHEMPHYSCHEM

SEN D, THAPA R, CHATTOPADHYAY KK

Voltage-dependent parameter extraction for graphene nanoribbon interconnect model through ab initio approach

THIN SOLID FILMS

YAMACLI S

Computational study of graphene growth on copper by first-principles and kinetic Monte Carlo calculations

JOURNAL OF MOLECULAR MODELING

TAIOLI S

First-principles study of nitrobenzene adsorption on graphene

APPLIED SURFACE SCIENCE

DAI ZH, ZHAO YC

On distance variation effects on graphene bilayers

JOURNAL OF PHYSICS CHEMISTRY OF SOLIDS

NAJI S, BHIHI M, LABRIM H, BELHAJ A, BENYOUSSEF A, EL KENZ A, LOULIDI M

Aluminum nitride graphene for DMMP nerve agent adsorption and detection

MATERIALS CHEMISTRY PHYSICS

GANJI MD, DALIRANDEH Z, KHOSRAVI A, FEREIDOON A

First-principles vdW-DF study on the enhanced hydrogen storage capacity of Pt-adsorbed graphene

JOURNAL OF MOLECULAR MODELING

KHOSRAVI A, FEREIDOON A, AHANGARI MG, GANJI MD, EMAMI SN